SCHEMBL3682897

SCHEMBL3682897

CC(C)(C)c1[c]c2c(cc1C(C)(C)C)-c1ccccc1C2

nearest known ligand 0.34

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.34
MAPT P10636 2/20 0.34
HPGD P15428 2/20 0.34
SMN1; SMN2 Q16637 2/20 0.34
KDM4E B2RXH2 2/20 0.34
NPC1 O15118 1/20 0.34
LMNA P02545 1/20 0.34
RAB9A P51151 1/20 0.34
TSHR P16473 1/20 0.33
ATM Q13315 1/20 0.33
NPSR1 Q6W5P4 1/20 0.33
HSD17B10 Q99714 1/20 0.32
MAOA P21397 2/20 0.32
PGR P06401 1/20 0.31
CYP1A2 P05177 1/20 0.31
ADRA2A P08913 1/20 0.31
SLC6A2 P23975 1/20 0.31
HTR2C P28335 1/20 0.31
SLC6A4 P31645 1/20 0.31
HTR2B P41595 1/20 0.31

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL16411254 0.82
SCHEMBL2963744 0.78 AR (0.34) ALDH1A1MAPTHPGDSMN1; SMN2KDM4E
SCHEMBL1029280 0.73 ALDH1A1 (0.38) ALDH1A1MAPTHPGDSMN1; SMN2KDM4E
SCHEMBL16411280 0.73
SCHEMBL8157205 0.72 ALDH1A1 (0.32) ALDH1A1MAPTHPGDSMN1; SMN2KDM4E
SCHEMBL218437 0.70 ALDH1A1 (0.38) ALDH1A1MAPTHPGDSMN1; SMN2KDM4E
SCHEMBL2051685 0.70 ALDH1A1 (0.38) ALDH1A1MAPTHPGDSMN1; SMN2KDM4E
SCHEMBL2960382 0.69 ALDH1A1 (0.37) ALDH1A1MAPTHPGDSMN1; SMN2KDM4E
SCHEMBL217539 0.69 ALDH1A1 (0.35) ALDH1A1MAPTHPGDSMN1; SMN2KDM4E
SCHEMBL16411546 0.68

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 97 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-111662338-B Monocyclopentadienyl fourth subgroup metal complex containing neutral amine or phosphine ligand side group and its use 吉林大学 2021-06-22 CN claimed
US-20140219911-A1 DIHYDROXYBIPYRIDINE COMPLEXES OF RUTHENIUM AND IRIDIUM FOR WATER OXIDATION AND HYDROGENATION THE BOARD OF TRUSTEES OF THE UNIVERSITY OF ALABAMA (US) 2014-08-07 US claimed
WO-2013033018-A2 DIHYDROXYBIPYRIDINE COMPLEXES OF RUTHENIUM AND IRIDIUM FOR WATER OXIDATION AND HYDROGENATION DREXEL UNIVERSITY (US) 2013-03-07 WO claimed
CN-114716585-B Catalyst system containing aryloxy side-arm metallocene fourth subgroup metal complex and application thereof 吉林大学 2023-02-28 CN disclosed
CN-113185545-B Benzylamino-containing side arm Shan Maodi quaternary metal complex and application thereof 吉林大学 2022-11-29 CN disclosed
CN-114716585-A Catalyst system containing aryloxy side-arm metallocene fourth subgroup metal complex and application thereof 吉林大学 2022-07-08 CN disclosed
CN-111729688-B Application of single cyclopentadienyl fourth subgroup metal complex containing neutral coordination side group 吉林大学 2021-08-17 CN disclosed
CN-113185545-A Benzyl amino side arm-containing half-metallocene fourth subgroup metal complex and application thereof 吉林大学 2021-07-30 CN disclosed
CN-111662338-B Monocyclopentadienyl fourth subgroup metal complex containing neutral amine or phosphine ligand side group and its use 吉林大学 2021-06-22 CN disclosed
CN-111729688-A Application of single cyclopentadienyl fourth subgroup metal complex containing neutral coordination side group 吉林大学 2020-10-02 CN disclosed
CN-111662338-A Monocyclopentadienyl fourth subgroup metal complex containing neutral amine or phosphine ligand side group and its use 吉林大学 2020-09-15 CN disclosed
US-6063949-A Stereorigid metallocene compound TARGOR GMBH (DE) 2000-05-16 US disclosed
EP-0987287-A1 THERMOPLASTIC ELASTOMER COMPOSITION POWDER, POWDER MOLDING PROCESS WITH THE SAME, AND MOLDINGS Sumitomo Chemical Company, Limited (JP) 2000-03-22 EP disclosed
EP-0970976-A1 Copolymer, process for production thereof, and molded article thereof SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2000-01-12 EP disclosed
EP-0970963-A2 Transition metal compound, olefin polymerization catalyst component, olefin polymerization catalyst and process for producing olefin polymer SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2000-01-12 EP disclosed
EP-0963990-A1 PROCESS FOR PRODUCING CYCLOPENTADIENYL METAL SALTS AND PROCESS FOR PRODUCING CYCLOPENTADIENE DERIVATIVES BY UTILIZING THE SAME SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1999-12-15 EP disclosed
EP-0852230-A1 TRANSITION METAL COMPLEXES, CATALYST FOR OLEFIN POLYMERIZATION, AND PROCESS FOR PRODUCING OLEFIN POLYMERS SUMITOMO CHEMICAL COMPANY LIMITED (JP) 1998-07-08 EP disclosed
EP-0842939-A1 TRANSITION METAL COMPLEX, PROCESS FOR THE PREPARATION THEREOF, POLYMERIZATION CATALYST FOR OLEFINS CONTAINING THE COMPLEX, AND PROCESS FOR PRODUCING OLEFIN POLYMERS SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1998-05-20 EP disclosed
EP-0749988-A2 Process for the preparation of cycloolefin copolymers HOECHST AKTIENGESELLSCHAFT (DE) 1996-12-27 EP disclosed
EP-0749985-A2 Stereo rigid metallocene compounds HOECHST AKTIENGESELLSCHAFT (DE) 1996-12-27 EP disclosed